{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.7607129 0.1029019 2.480933 ] [ 0.9158836 2.552597 0.2381701 ] [ 0.8989231 2.268448 2.632769 ] [ 2.109562 0.2713555 0.0459784 ] [ 2.969591 1.985029 0.1686784 ] [ 2.973458 2.362165 2.304699 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.607129000000001e-11 1.029019e-11 2.480933e-10 ] [ 9.158836e-11 2.552597e-10 2.381701e-11 ] [ 8.989231e-11 2.268448e-10 2.632769e-10 ] [ 2.109562e-10 2.713555e-11 4.59784e-12 ] [ 2.969591e-10 1.985029e-10 1.686784e-11 ] [ 2.973458e-10 2.362165e-10 2.304699e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.9752371 -0.9050499 -1.5331643 ] [ -2.2963967 0.369515 0.186623 ] [ -2.7378325 1.2064156 0.3032982 ] [ -4.9894194 -8.0309383 0.7843831 ] [ 6.358651 7.1575852 -1.3062416 ] [ 2.6897604 0.2024725 1.5651016 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.562502081356792e-09 -1.450049790437378e-09 -2.456399997305197e-09 ] [ -3.679233104822271e-09 5.92028294034912e-10 2.990030075035584e-10 ] [ -4.386491223166417e-09 1.932890869288405e-09 4.859372851707226e-10 ] [ -7.993931114045963e-09 -1.28669815873473e-08 1.256720264570629e-09 ] [ 1.018768197202654e-08 1.146771566882409e-08 -2.092829752636385e-09 ] [ 4.309471228433656e-09 3.24396705854928e-10 2.507569192696673e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -14.437909 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.313208025303791e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.4554024 0.2019697 2.4549181 ] [ 0.7868184 2.504129 0.0749503 ] [ 0.6319938 2.4599158 2.4432382 ] [ 1.6102082 0.24618 0.0866265 ] [ 3.1492639 2.0872529 0.2216026 ] [ 2.9944439 2.0430489 2.5898921 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.4554024e-10 2.019697e-11 2.4549181e-10 ] [ 7.868184000000001e-11 2.504129e-10 7.49503e-12 ] [ 6.319938e-11 2.4599158e-10 2.4432382e-10 ] [ 1.6102082e-10 2.4618e-11 8.66265e-12 ] [ 3.1492639e-10 2.0872529e-10 2.216026e-11 ] [ 2.9944439e-10 2.0430489e-10 2.5898921e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.23e-05 1.07e-05 -1.16e-05 ] [ -1.3e-05 -7e-07 -1.15e-05 ] [ 1.87e-05 -6.3e-06 6.6e-06 ] [ 1.56e-05 2.4e-06 8e-06 ] [ -1.03e-05 -3.9e-06 3.6e-06 ] [ 1.4e-06 -2.2e-06 4.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.970677243584e-14 1.714328984256e-14 -1.858524880128e-14 ] [ -2.08282960704e-14 -1.12152363456e-15 -1.84250311392e-14 ] [ 2.996070280896e-14 -1.009371271104e-14 1.057436569728e-14 ] [ 2.499395528448e-14 3.84522388992e-15 1.28174129664e-14 ] [ -1.650241919424e-14 -6.24848882112e-15 5.76783583488e-15 ] [ 2.24304726912e-15 -3.52478856576e-15 7.850665441919999e-15 ] ] } "relaxed-potential-energy" { "source-value" -17.513765 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.806014482518531e-18 } }